Bioactive Compound Details

BioIDbio1919
NameOSEMOZOTAN
ChEMBL IDCHEMBL1742408
Molecular FormulaC19H21NO5
Molecular Weight343.38
Molecular Weight (Monoisotopic)343.142
TypeSmall molecule
Max PhasePhase 3
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsMKC-242|MN-305|Osemozotan
Smilesc1ccc2c(c1)OC[C@H](CNCCCOc1ccc3c(c1)OCO3)O2
InchiInChI=1S/C19H21NO5/c1-2-5-18-16(4-1)22-12-15(25-18)11-20-8-3-9-21-14-6-7-17-19(10-14)24-13-23-17/h1-2,4-7,10,15,20H,3,8-9,11-13H2/t15-/m0/s1
Inchi KeyMEEQBDCQPIZMLY-HNNXBMFYSA-N
Molecular SpeciesBASE
Targets3.0
Bioactivities6.0
Np Likeness Score-0.3
Records Key['OSEMOZOTAN', 'OSEMOZOTAN', 'OSEMOZOTAN', 'osemozotan', 'osemozotan', 'osemozotan']
Records Name['OSEMOZOTAN', 'OSEMOZOTAN', 'OSEMOZOTAN', 'osemozotan', 'osemozotan', 'osemozotan']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure